(2R)-8-fluorooctan-2-ol

C8H17FO — CID 54347912

IUPAC(2R)-8-fluorooctan-2-ol
SMILESC[C@@H](O)CCCCCCF
InChIInChI=1S/C8H17FO/c1-8(10)6-4-2-3-5-7-9/h8,10H,2-7H2,1H3/t8-/m1/s1
InChIKeyUDPIIIYQWZWDFT-MRVPVSSYSA-N
MW148.22 g/mol
LogP2.29
Rot. Bonds6

About (2R)-8-fluorooctan-2-ol

(2R)-8-fluorooctan-2-ol (PubChem CID 54347912) has the molecular formula C8H17FO and a molecular weight of 148.22 g/mol. Its IUPAC name is (2R)-8-fluorooctan-2-ol.

Molecular Properties

Compound Name(2R)-8-fluorooctan-2-ol
PubChem CID54347912
Molecular FormulaC8H17FO
Molecular Weight148.22 g/mol
Exact Mass148.13
IUPAC Name(2R)-8-fluorooctan-2-ol
SMILESC[C@@H](O)CCCCCCF
InChIInChI=1S/C8H17FO/c1-8(10)6-4-2-3-5-7-9/h8,10H,2-7H2,1H3/t8-/m1/s1
InChIKeyUDPIIIYQWZWDFT-MRVPVSSYSA-N
XLogP2.29
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.22
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2S)-octadecan-2-ol
CID 25022019
1,8-difluorononane
CID 168864691
(10S)-undecane-1,10-diol
CID 129382222
henicosane-1,20-diol
CID 86247204
hexadecane-1,15-diol
CID 53400630
docosan-2-ol
CID 14151025
octan-2-ol
CID 20083
1,6-difluoroheptane
CID 139983024
heptane;heptan-2-ol
CID 157400640
henicosan-2-ol
CID 14151023
octan-2-ol;vanadium
CID 175998662
(2S)-8-iodooctan-2-ol
CID 139766789

Frequently Asked Questions

What is the IUPAC name of (2R)-8-fluorooctan-2-ol?
The IUPAC name of (2R)-8-fluorooctan-2-ol (CID 54347912) is (2R)-8-fluorooctan-2-ol.
What is the SMILES notation for (2R)-8-fluorooctan-2-ol?
The canonical SMILES for (2R)-8-fluorooctan-2-ol is C[C@@H](O)CCCCCCF.
What is the InChIKey of (2R)-8-fluorooctan-2-ol?
The InChIKey is UDPIIIYQWZWDFT-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H17FO/c1-8(10)6-4-2-3-5-7-9/h8,10H,2-7H2,1H3/t8-/m1/s1.
What are the key properties of (2R)-8-fluorooctan-2-ol?
(2R)-8-fluorooctan-2-ol has a molecular weight of 148.22 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-8-fluorooctan-2-ol is sourced from PubChem (CID 54347912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).